SCHEMBL3933002

SCHEMBL3933002

CCNC(=O)Nc1ccc(-c2nc(N3CCOCC3)cc(C3(S(C)(=O)=O)CC3)n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 7/20 0.71
PIK3CD O00329 4/20 0.71
ATR Q13535 3/20 0.66
MTOR P42345 13/20 0.61
PIK3CG P48736 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3938023 0.93 ATR (0.64) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3931991 0.91 ATR (0.64) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3930394 0.91 PIK3CA (0.65) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3926881 0.91 PIK3CA (0.65) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3925867 0.90 ATR (0.69) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3927511 0.90 ATR (0.61) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3930221 0.89 PIK3CA (0.63) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3926689 0.89 ATR (0.61) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3932941 0.88 PIK3CA (0.62) PIK3CAPIK3CDATRMTORPIK3CG
SCHEMBL3937382 0.88 ATR (0.60) PIK3CAPIK3CDATRMTORPIK3CG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101801962-A Trisubstituted pyrimidine derivatives for the treatment of proliferative diseases ASTRAZENECA AB 2010-08-11 CN disclosed
EP-2074118-A2 TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES AstraZeneca AB (SE) 2009-07-01 EP disclosed
US-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 US disclosed
US-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 US disclosed
US-20090018134-A1 Compounds - 945 ASTRAZENECA AB (SE) 2009-01-15 US disclosed
WO-2009007748-A2 TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA AB (SE) 2009-01-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090018134-A1 Compounds - 945 MTOR, PIK3CA, PIK3R5 PIK3CA 2/4885PIK3CD 4/4885ATR 1185/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.